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CAS 81348-83-6 Momordicoside L molecular structure lightbox
CAS RN: 81348-83-6

Momordicoside L

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260402 5mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS81348-83-6
  • Purity/Analytical Methods: >99.0%
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81348-83-6 / 3-hydroxy-17-[(E)-6-hydroxy-6-methylhept-4-en-2-yl]-4,4,13,14-tetramethyl-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-9-carbaldehyde

Standard CAS: 81348-83-6 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
81348-83-6
Multi CAS
Yes
Molecular Formula
C36H58O9
Molecular Weight
634.800000
Exact Mass
634.408083
InChI
InChI=1S/C36H58O9/c1-20(9-8-13-32(2,3)43)21-12-14-35(7)30-24(44-31-29(42)28(41)27(40)25(18-37)45-31)17-23-22(10-11-26(39)33(23,4)5)36(30,19-38)16-15-34(21,35)6/h8,13,17,19-22,24-31,37,39-43H,9-12,14-16,18H2,1-7H3/b13-8+/t20-,21-,22-,24+,25-,26+,27-,28+,29-,30+,31-,34-,35+,36-/m1/s1
InChIKey
BOHOBTRHAFBJOW-MLFDEFIASA-N

Physical Properties

Melting Point
227 - 232 °C
Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
45
Fraction Csp3
0.86
Rotatable bonds
8
H-bond acceptors
9
H-bond donors
6
Molar refractivity
168.61
TPSA
156.91

LogP / Solubility

WLOGP
3.28
MLOGP
2.94
XLogP3
3.1
Consensus LogP
3.11
Log S (ESOL)
-5.31
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.13
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.47
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-4.26

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10

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